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. 2024 Apr 22;52(W1):W432–W438. doi: 10.1093/nar/gkae298

Table 1.

Statistics and comparison between admetSAR3.0 and existing tools

admetSAR3.0 admetSAR2.0 ADMETlab2.0 SwissADME vNN-ADMET pkCSM ADMET-AI ADMETboost ProTOX-II Danish QSAR Models
Endpoints
Basic property 18 6 30 28 0 7 8 9 9 0
ADME 39 24 23 9 9 19 22 16 0 2
Human health toxicity 43 21 23 0 6 8 18 4 17 48
Ecological risk 16 5 4 0 0 2 0 0 0 4
Cosmetic risk 9 3 3 1 0 1 1 0 0 7
Total +++++ +++ ++++ ++ ++ ++ +++ ++ ++ +++
Functions
Search
Optimization
Prediction +++++ +++ ++++ +++ +++ ++ ++++ + +++ +++
Batch evaluation +++ + ++ +++ + ++ +++ - - -
Application domain
Speed (1000 molecules) 12s 315s 96s 1830s 2411s 1910s 101s - - -